1-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-5,6,7,8-tetrahydroisoquinoline

Systemtic Name: 1-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-5,6,7,8-tetrahydroisoquinoline Openeye Name: 1-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-5,6,7,8-tetrahydroisoquinoline CAS Name: 1-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-5,6,7,8-tetrahydroisoquinoline IUPAC Name: 1-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-5,6,7,8-tetrahydroisoquinoline Traditional Name: 1-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-5,6,7,8-tetrahydroisoquinoline Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SCC3=NC=CC4=C3CCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SCC3=NC=CC4=C3CCCC4

InChI

InChI=1S/C18H19N3OS/c1-22-13-6-7-15-16(10-13)21-18(20-15)23-11-17-14-5-3-2-4-12(14)8-9-19-17/h6-10H,2-5,11H2,1H3,(H,20,21)